Vitas-M small molecule compound
ethyl (2Z)-2-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK392829
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1cc3OCOc3cc1Cl)/s2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H19ClN2O5S MW 482.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN2O5S/c1-3-30-23(29)20-13(2)26-24-27(21(20)14-7-5-4-6-8-14)22(28)19(33-24)10-15-9-17-18(11-16(15)25)32-12-31-17/h4-11,21H,3,12H2,1-2H3/b19-10-InChIKey
SKCKCAGTTOBMDE-GRSHGNNSSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1cc3OCOc3cc1Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC5=C(C=C4Cl)OCO5)S2)C
ethyl(2Z)2((6chloro13benzodioxol5yl)methylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((6CHLORO13BENZODIOXOL5YL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC24H19ClN2O5Sc133023(29)2013(2)262427(21(20)147546814)22(28)19(3324)101591718(1116(15)25)32123117h41121H312H212H3b1910
MFCD01824895
ZINC000016682338
ZINC000016682339
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